2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine

C16H24N4 — CID 135039001

IUPAC2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine
SMILESCN(C)C1=CC(=C2C=C(N(C)C)C=CN2C)N(C)C=C1
InChIInChI=1S/C16H24N4/c1-17(2)13-7-9-19(5)15(11-13)16-12-14(18(3)4)8-10-20(16)6/h7-12H,1-6H3
InChIKeyPKUVCCVLVVVGBL-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.01
Rot. Bonds2

About 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine

2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine (PubChem CID 135039001) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine.

Molecular Properties

Compound Name2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine
PubChem CID135039001
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine
SMILESCN(C)C1=CC(=C2C=C(N(C)C)C=CN2C)N(C)C=C1
InChIInChI=1S/C16H24N4/c1-17(2)13-7-9-19(5)15(11-13)16-12-14(18(3)4)8-10-20(16)6/h7-12H,1-6H3
InChIKeyPKUVCCVLVVVGBL-UHFFFAOYSA-N
XLogP2.01
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine?
The IUPAC name of 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine (CID 135039001) is 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine.
What is the SMILES notation for 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine?
The canonical SMILES for 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine is CN(C)C1=CC(=C2C=C(N(C)C)C=CN2C)N(C)C=C1.
What is the InChIKey of 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine?
The InChIKey is PKUVCCVLVVVGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-17(2)13-7-9-19(5)15(11-13)16-12-14(18(3)4)8-10-20(16)6/h7-12H,1-6H3.
What are the key properties of 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine?
2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine has a molecular weight of 272.40 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)-1-methyl-2-pyridinylidene]-N,N,1-trimethylpyridin-4-amine is sourced from PubChem (CID 135039001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).